| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 35 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.91 | 13.39 | -99.9 | 0 | 8 | -2 | 123 | 490.537 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.32 | 12.45 | -59.14 | 0 | 8 | -1 | 117 | 491.545 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.91 | 11.15 | -63.61 | 1 | 8 | -1 | 120 | 491.545 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
